2-(1-benzothiophen-3-yl)-N-[1-(cyanomethylamino)-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: 2-(1-benzothiophen-3-yl)-N-[1-(cyanomethylamino)-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 2-(benzothiophen-3-yl)-N-[2-(cyanomethylamino)-1-methyl-2-oxo-ethyl]benzamide CAS Name: 2-(1-benzothiophen-3-yl)-N-[1-(cyanomethylamino)-1-oxopropan-2-yl]benzamide IUPAC Name: 2-(1-benzothiophen-3-yl)-N-[1-(cyanomethylamino)-1-oxopropan-2-yl]benzamide Traditional Name: 2-(benzothiophen-3-yl)-N-[2-(cyanomethylamino)-2-keto-1-methyl-ethyl]benzamide Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC#N)NC(=O)C1=CC=CC=C1C2=CSC3=CC=CC=C32

Isomeric SMILES

CC(C(=O)NCC#N)NC(=O)C1=CC=CC=C1C2=CSC3=CC=CC=C32

InChI

InChI=1S/C20H17N3O2S/c1-13(19(24)22-11-10-21)23-20(25)16-8-3-2-6-14(16)17-12-26-18-9-5-4-7-15(17)18/h2-9,12-13H,11H2,1H3,(H,22,24)(H,23,25)